General Information of the Compound
| Compound ID |
CP0517231
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| Compound Name |
US9422293, 28
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| Structure |
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| Formula |
C19H17F3N6
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| Molecular Weight |
386.381
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2ncnc3CCN(CCc23)c2cnccn2)cc1
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| InChI |
InChI=1S/C19H17F3N6/c20-19(21,22)13-1-3-14(4-2-13)27-18-15-5-9-28(17-11-23-7-8-24-17)10-6-16(15)25-12-26-18/h1-4,7-8,11-12H,5-6,9-10H2,(H,25,26,27)
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| InChIKey |
JUQQXPLCNOCIOJ-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1